Fluids and electrolytes under confinement in single-digit nanopores

NR Aluru, F Aydin, MZ Bazant, D Blankschtein… - Chemical …, 2023 - ACS Publications
Confined fluids and electrolyte solutions in nanopores exhibit rich and surprising physics
and chemistry that impact the mass transport and energy efficiency in many important …

Atomic Insights into Advances and Issues in Low‐Temperature Electrolytes

R Hou, S Guo, H Zhou - Advanced Energy Materials, 2023 - Wiley Online Library
The design of low‐temperature electrolytes is a key technology to improve the low‐
temperature performance of electrochemical energy storage devices and expand their …

Quasi‐solid aqueous electrolytes for low‐cost sustainable alkali‐metal batteries

X Yi, Y Feng, AM Rao, J Zhou, C Wang… - Advanced …, 2023 - Wiley Online Library
Aqueous electrolytes are highly important for batteries due to their sustainability, greenness,
and low cost. However, the free water molecules react violently with alkali metals, rendering …

Hydrogen-bond regulation in organic/aqueous hybrid electrolyte for safe and high-voltage K-ion batteries

M **a, H Fu, K Lin, AM Rao, L Cha, H Liu… - Energy & …, 2024 - pubs.rsc.org
High reliability and proven ultra-long life make aqueous batteries ideal for grid energy
storage. However, the narrow electrochemical stability window (ESW) caused by the high …

[HTML][HTML] Evaluation of the MACE force field architecture: From medicinal chemistry to materials science

DP Kovács, I Batatia, ES Arany… - The Journal of Chemical …, 2023 - pubs.aip.org
The MACE architecture represents the state of the art in the field of machine learning force
fields for a variety of in-domain, extrapolation, and low-data regime tasks. In this paper, we …

Temperature-pressure phase diagram of confined monolayer water/ice at first-principles accuracy with a machine-learning force field

B Lin, J Jiang, XC Zeng, L Li - Nature Communications, 2023 - nature.com
Understanding the phase behaviour of nanoconfined water films is of fundamental
importance in broad fields of science and engineering. However, the phase behaviour of the …

Nanofluidics

T Emmerich, N Ronceray, KV Agrawal… - Nature Reviews …, 2024 - nature.com
Fluid transport at the nanoscale is ubiquitous in nature. However, rigorous study of fluid flow
and structure in artificial nanopores only emerged relatively recently. Termed nanofluidics …

Machine learned coarse-grained protein force-fields: Are we there yet?

AEP Durumeric, NE Charron, C Templeton… - Current opinion in …, 2023 - Elsevier
The successful recent application of machine learning methods to scientific problems
includes the learning of flexible and accurate atomic-level force-fields for materials and …

Nanoconfinement-triggered oligomerization pathway for efficient removal of phenolic pollutants via a Fenton-like reaction

X Zhang, J Tang, L Wang, C Wang, L Chen… - Nature …, 2024 - nature.com
Heterogeneous Fenton reaction represents one of the most reliable technologies to ensure
water safety, but is currently challenged by the sluggish Fe (III) reduction, excessive input of …

Water-induced strong isotropic MXene-bridged graphene sheets for electrochemical energy storage

J Yang, M Li, S Fang, Y Wang, H He, C Wang, Z Zhang… - Science, 2024 - science.org
Graphene and two-dimensional transition metal carbides and/or nitrides (MXenes) are
important materials for making flexible energy storage devices because of their electrical …